9-prop-2-enylcarbazole

C15H13N — CID 3090393

IUPAC9-prop-2-enylcarbazole
SMILESC=CCn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13N/c1-2-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h2-10H,1,11H2
InChIKeyGHBQLFWTMLRYKN-UHFFFAOYSA-N
MW207.28 g/mol
LogP3.98
Rot. Bonds2

About 9-prop-2-enylcarbazole

9-prop-2-enylcarbazole (PubChem CID 3090393) has the molecular formula C15H13N and a molecular weight of 207.28 g/mol. Its IUPAC name is 9-prop-2-enylcarbazole.

Molecular Properties

Compound Name9-prop-2-enylcarbazole
PubChem CID3090393
Molecular FormulaC15H13N
Molecular Weight207.28 g/mol
Exact Mass207.10
IUPAC Name9-prop-2-enylcarbazole
SMILESC=CCn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13N/c1-2-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h2-10H,1,11H2
InChIKeyGHBQLFWTMLRYKN-UHFFFAOYSA-N
XLogP3.98
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-prop-2-enylcarbazole?
The IUPAC name of 9-prop-2-enylcarbazole (CID 3090393) is 9-prop-2-enylcarbazole.
What is the SMILES notation for 9-prop-2-enylcarbazole?
The canonical SMILES for 9-prop-2-enylcarbazole is C=CCn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-prop-2-enylcarbazole?
The InChIKey is GHBQLFWTMLRYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N/c1-2-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h2-10H,1,11H2.
What are the key properties of 9-prop-2-enylcarbazole?
9-prop-2-enylcarbazole has a molecular weight of 207.28 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-prop-2-enylcarbazole is sourced from PubChem (CID 3090393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).